4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=24.616685314478392 stress="-7.238911501065673 1.3399696830094445 0.03956377181111169 1.3399696830094445 -5.636715102741871 0.3160960697003266 0.03956377181111169 0.3160960697003266 -5.009667363886508" pbc="T F F" Nb 0.10989136 0.06729228 0.07022621 -12.66381684 -43.53231820 -38.56444772 Nb 1.60537101 1.20641190 0.26767637 12.35442729 60.85386548 -51.74871089 Nb 1.21243667 0.17842378 1.64553500 39.61343333 -83.59833398 58.75475261 Nb 0.14594781 1.45785282 1.74717822 -39.30404377 66.27678669 31.55840601